About 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane
3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane (PubChem CID 150262793) has the molecular formula C10H26O4S3Si2
and a molecular weight of 362.69 g/mol. Its IUPAC name is 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane.
Molecular Properties
| Compound Name | 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane |
| PubChem CID | 150262793 |
| Molecular Formula | C10H26O4S3Si2 |
| Molecular Weight | 362.69 g/mol |
| Exact Mass | 362.05 |
| IUPAC Name | 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane |
| SMILES | CO[SiH](CCCSSSCCC[SiH](OC)OC)OC |
| InChI | InChI=1S/C10H26O4S3Si2/c1-11-18(12-2)9-5-7-15-17-16-8-6-10-19(13-3)14-4/h18-19H,5-10H2,1-4H3 |
| InChIKey | GBXAIJFPXXZOBL-UHFFFAOYSA-N |
| XLogP | 2.82 |
| TPSA | 36.92 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 362.69 |
| LogP ≤ 5 | 2.82 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 7 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane?
The IUPAC name of 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane (CID 150262793) is 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane.
What is the SMILES notation for 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane?
The canonical SMILES for 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane is CO[SiH](CCCSSSCCC[SiH](OC)OC)OC.
What is the InChIKey of 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane?
The InChIKey is GBXAIJFPXXZOBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26O4S3Si2/c1-11-18(12-2)9-5-7-15-17-16-8-6-10-19(13-3)14-4/h18-19H,5-10H2,1-4H3.
What are the key properties of 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane?
3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane has a molecular weight of 362.69 g/mol, XLogP of 2.82, 14 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-dimethoxysilylpropyltrisulfanyl)propyl-dimethoxysilane is sourced from PubChem (CID 150262793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).